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首页> 外文期刊>Asian Journal of Chemistry: An International Quarterly Research Journal of Chemistry >Energy Dispersive EXAFS Performance Studies on Tiphodalphosphine Rhdoium Biphasic Catalysts for Hydrogenation and Hydroformylation of Olefins
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Energy Dispersive EXAFS Performance Studies on Tiphodalphosphine Rhdoium Biphasic Catalysts for Hydrogenation and Hydroformylation of Olefins

机译:硫代膦膦铑双相催化剂加氢和加氢甲酰化的能量分散EXAFS性能研究

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摘要

Energy dispersive EXAFS (EDE) data have been analyzed for the hydrogenation of styrene by the rhodium zwitterionic Rh(I) complexes,Rh(sulphos)(cod) and hydroformylation of 1-hexene by the Rh(sulphos) (CO)_2 using curved wave theory with ab initio phase-shifts.The derived parameters for metal compounds were in good agreement within experimental error of 0.02-0.05 A for the bond distances.The bond lengths in the rhodium complexes were refined at average distances of Rh-C 1.90 A,Rh-P 2.31 A and Rh-O 2.90 A consistently.This is a good start for the quantitative analysis of the dispersive EXAFS techniques at variable temperatures and high pressures.
机译:能量色散EXAFS(EDE)数据已通过两性离子铑Rh(I)配合物,Rh(sulphos)(cod)的苯乙烯氢化和使用Rh(sulphos)(CO)_2的1-己烯加氢甲酰化进行了曲线分析从头算相移的波动理论。金属化合物的衍生参数在键距为0.02-0.05 A的实验误差内吻合良好。铑络合物的键长在Rh-C的平均距离为1.90 A时得到了改进。 ,Rh-P 2.31 A和Rh-O 2.90 A一致。这是定量分析可变EXAFS技术在可变温度和高压下的良好起点。

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